SCHEMBL4072679

SCHEMBL4072679

CSOC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.58
LMNA P02545 2/20 0.56
F2 P00734 1/20 0.56
ALDH1A1 P00352 5/20 0.48
TDP1 Q9NUW8 4/20 0.48
HSD17B10 Q99714 1/20 0.48
KMT2A Q03164 5/20 0.47
PKM P14618 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 3/20 0.45
MAPK1 P28482 1/20 0.45
HIF1A Q16665 1/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28202295 0.98 TSHR (0.56) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL28820918 0.88 CA1 (0.44) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL9679649 0.81 LMNA (0.61) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL5835571 0.81 LMNA (0.61) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL15573246 0.81 HSD17B10 (0.47) LMNAALDH1A1TDP1HSD17B10KMT2A
SCHEMBL15572350 0.81 HSD17B10 (0.47) LMNAALDH1A1TDP1HSD17B10KMT2A
SCHEMBL15572208 0.81 HSD17B10 (0.47) LMNAALDH1A1TDP1HSD17B10KMT2A
SCHEMBL15573214 0.81 HSD17B10 (0.47) LMNAALDH1A1TDP1HSD17B10KMT2A
SCHEMBL23998048 0.78 TPMT (0.46) TDP1
SCHEMBL4737799 0.78 CES2 (0.52) TSHRLMNAF2ALDH1A1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107686468-A Contain the recovery method of the ketone of 1,2 benzisothiazole 3 in a kind of solvent 连云港市三联化工有限公司 2018-02-13 CN claimed
CN-107602501-A The synthetic method of the ketone of 1,2 benzisothiazole of N normal-butyls 3 连云港市三联化工有限公司 2018-01-19 CN claimed
CN-103694194-A Synthesis method of 2-methyl-1, 2-benzisothiazolin-3-ketone SHOUGUANG SYNTECH FINE CHEMICAL CO LTD 2014-04-02 CN claimed
CN-103664817-A Synthesis method for 2-butyl-1, 2-benzisothiazolin-3-ketone SHOUGUANG XINTAI FINE CHEMICAL CO LTD 2014-03-26 CN claimed
CN-101817770-B Method for preparing methylthio-benzoic acid UNIV JIANGSU POLYTECHNIC 2013-06-19 CN claimed
CN-101712641-B Method for preparing methylthio benzoic acid UNIV JIANGSU POLYTECHNIC 2013-05-08 CN claimed
CN-101817770-A Method for preparing methylthio-benzoic acid UNIV JIANGSU POLYTECHNIC 2010-09-01 CN claimed
CN-101712641-A Method for preparing methylthio benzoic acid UNIV JIANGSU POLYTECHNIC 2010-05-26 CN claimed
CN-116634871-A Pesticidal compounds and compositions, methods of use and methods of preparation thereof 阿达玛马克西姆有限公司 2023-08-22 CN disclosed
CN-116283785-A Sulfhydryl compound and preparation method thereof 华能武汉发电有限责任公司 2023-06-23 CN disclosed
US-11673910-B2 Macrolides with modified desosamine sugars and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2023-06-13 US disclosed
US-11382924-B2 Compounds and pharmaceutical uses thereof SYNEURX INTERNATIONAL (TAIWAN) CORP. (TW) 2022-07-12 US disclosed
CN-109311839-B Methylamine derivatives as lysyl oxidase inhibitors for the treatment of cancer 癌症研究协会皇家癌症医院 2021-11-02 CN disclosed
EP-3849972-A1 IMMUNOMODULATORS, COMPOSITIONS AND METHODS THERE OF Betta Pharmaceuticals Co., Ltd (CN) 2021-07-21 EP disclosed
CN-101817770-A Method for preparing methylthio-benzoic acid UNIV JIANGSU POLYTECHNIC 2010-09-01 CN disclosed
CN-101712641-A Method for preparing methylthio benzoic acid UNIV JIANGSU POLYTECHNIC 2010-05-26 CN disclosed
EP-2084136-A1 BENZOYLPYRAZOLE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND HERBICIDES CONTAINING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 2009-08-05 EP disclosed
WO-2008065907-A1 BENZOYLPYRAZOLE COMPOUNDS, PROCESS FOR THEIR PRODUCTION AND HERBICIDES CONTAINING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 2008-06-05 WO disclosed
EP-1644334-A1 ANTITHROMBOTIC ETHERS Eli Lilly and Company (US) 2006-04-12 EP disclosed
WO-2004108677-A1 ANTITHROMBOTIC ETHERS ELI LILLY AND COMPANY (US) 2004-12-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11673910-B2 Macrolides with modified desosamine sugars and uses thereof FUT6, DDOST, MGAM TSHR 2609/4885LMNA 1332/4885F2 4876/4885
US-11382924-B2 Compounds and pharmaceutical uses thereof ACE, ACE2, FURIN TSHR 4243/4885LMNA 2707/4885F2 247/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.